SCHEMBL9155384

SCHEMBL9155384

COC(C)=C(C(=O)O)c1ccccc1Oc1cccc(Nc2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.47
SIRT1 Q96EB6 1/20 0.47
MTNR1B P49286 5/20 0.47
MTNR1A P48039 3/20 0.47
KDM4E B2RXH2 2/20 0.45
POLB P06746 2/20 0.45
CYP1A2 P05177 1/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
RAB9A P51151 2/20 0.42
AKR1C3 P42330 2/20 0.42
AKR1C2 P52895 2/20 0.42
MAPK1 P28482 2/20 0.42
HTT P42858 2/20 0.42
PKM P14618 1/20 0.42
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 1/20 0.41
CTNNB1 P35222 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL202626 0.87 KDM4E (0.57) MTNR1BMTNR1AKDM4EPOLBCYP1A2
SCHEMBL203718 0.87 CTNNB1 (0.54) KDM4EMEN1KMT2ARAB9AHTT
SCHEMBL204355 0.84 L3MBTL1 (0.44) MTNR1BKDM4EPOLBMEN1KMT2A
SCHEMBL203989 0.84 KDM4E (0.44) MTNR1BKDM4EPOLBMEN1KMT2A
SCHEMBL203538 0.83 LMNA (0.51) MTNR1BKDM4EPOLBRAB9AMAPK1
SCHEMBL7759486 0.82 PTGS1 (0.41) MTNR1BMTNR1AKDM4EPOLBMEN1
SCHEMBL204217 0.82 LMNA (0.47) MTNR1BKDM4EPOLBKMT2ARAB9A
SCHEMBL8603089 0.82 LMNA (0.47) MTNR1BKDM4EPOLBKMT2ARAB9A
SCHEMBL204209 0.82 PTGS1 (0.41) MTNR1BMTNR1AKDM4EPOLBMEN1
SCHEMBL205379 0.82 MEN1 (0.49) MTNR1BKDM4EPOLBCYP1A2MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5468857-A Phenylmethoxypropenoic esters IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-11-21 US disclosed
US-5334748-A A methyl 2-aryl heterofunctional phenoxyphenyl-3-methoxy-propenoate compound; treating the plant diseases IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-08-02 US disclosed
EP-0307103-A2 Fungicides ZENECA LIMITED (GB) 1989-03-15 EP disclosed